KEGG   COMPOUND: C12354Help
Entry
C12354                      Compound                               

Name
3,5,7,9,11,13,15,17,19-Nonaoxo-eicosanoyl-[acp]
Formula
C20H21O10SR
Structure
Mol fileKCF fileDB search
Comment
Generic compound in reaction hierarchy
Reaction
Pathway
map01056  Biosynthesis of type II polyketide backbone
map01100  Metabolic pathways
map01130  Biosynthesis of antibiotics
Module
M00778  Type II polyketide backbone biosynthesis, acyl-CoA + malonyl-CoA => polyketide
Enzyme
2.3.1.235       2.3.1.-         4.2.1.-
Brite
Lipids [BR:br08002]
 FA  Fatty acyls
  FA07 Fatty esters
   FA0706 Fatty acyl ACPs
    C12354  3,5,7,9,11,13,15,17,19-Nonaoxo-eicosanoyl-[acp]
BRITE hierarchy
Other DBs
PubChem: 582744
ChEBI: 31095
LIPIDMAPS: LMFA07060027
KCF data Show

ATOM        32
            1   S2a S    35.3754  -17.6367
            2   C1b C    30.5293  -17.6367
            3   C1a C    11.1582  -17.6868
            4   C5a C    12.3720  -16.9851
            5   C1b C    13.5765  -17.6772
            6   C5a C    14.7903  -16.9755
            7   O5a O    14.7862  -15.5719
            8   O5a O    12.3679  -15.5815
            9   C1b C    15.9947  -17.6679
            10  C5a C    17.2085  -16.9660
            11  C1b C    18.4226  -17.6679
            12  C5a C    19.6363  -16.9566
            13  C1b C    20.8408  -17.6583
            14  C5a C    22.0450  -16.9566
            15  C1b C    23.2684  -17.6488
            16  O5a O    17.2044  -15.5626
            17  O5a O    19.6323  -15.5626
            18  O5a O    22.0410  -15.5530
            19  C5a C    24.4729  -16.9471
            20  C1b C    25.6867  -17.6488
            21  C5a C    26.8911  -16.9375
            22  C1b C    28.1049  -17.6394
            23  C5a C    29.3189  -16.9375
            24  O5a O    24.4688  -15.5435
            25  O5a O    26.8870  -15.5435
            26  O5a O    29.3148  -15.5341
            27  C5a C    31.7276  -16.9282
            28  C1b C    32.9414  -17.6299
            29  C5a C    34.1459  -16.9282
            30  O5a O    31.7326  -15.5246
            31  O5a O    34.1473  -15.5246
            32  R   R    36.7754  -17.6367
BOND        31
            1     9  10 1
            2    14  18 2
            3    15  19 1
            4    10  11 1
            5    19  20 1
            6     6   7 2
            7    20  21 1
            8    11  12 1
            9    21  22 1
            10    4   5 1
            11   22  23 1
            12   23   2 1
            13   12  13 1
            14   19  24 2
            15    4   8 2
            16   21  25 2
            17   13  14 1
            18   23  26 2
            19    3   4 1
            20    2  27 1
            21   14  15 1
            22   27  28 1
            23    6   9 1
            24   28  29 1
            25   29   1 1
            26   10  16 2
            27   27  30 2
            28    5   6 1
            29   29  31 2
            30   12  17 2
            31    1  32 1

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